N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(2-methoxyethanoyl)piperazine-2-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(2-methoxyethanoyl)piperazine-2-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(2-methoxyacetyl)piperazine-2-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-1-(2-methoxy-1-oxoethyl)-2-piperazinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-1-(2-methoxyacetyl)piperazine-2-carboxamide Traditional Name: N-homopiperonyl-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(2-methoxyacetyl)piperazine-2-carboxamide Formula: C25H29N7O5 MolecularWeight: 507.54166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCCC4=CC5=C(C=C4)OCO5)C(=O)COC

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCCC4=CC5=C(C=C4)OCO5)C(=O)COC

InChI

InChI=1S/C25H29N7O5/c1-17-11-22(29-25(28-17)31-8-7-26-15-31)30-9-10-32(23(33)14-35-2)19(13-30)24(34)27-6-5-18-3-4-20-21(12-18)37-16-36-20/h3-4,7-8,11-12,15,19H,5-6,9-10,13-14,16H2,1-2H3,(H,27,34)